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{
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{
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"created_at": "2022-09-04T14:43:09.570991Z",
"structure_string": "Li4 Fe4 P8 O28\n1.0\n10.169150 0.000000 0.000000\n0.000000 7.120467 0.000000\n0.000000 2.913138 7.541624\nLi Fe P O\n4 4 8 28\ndirect\n0.843428 0.896645 0.552415 Li\n0.656572 0.896645 0.052415 Li\n0.343428 0.103355 0.947585 Li\n0.156572 0.103355 0.447585 Li\n0.393858 0.764417 0.755304 Fe\n0.106142 0.764417 0.255304 Fe\n0.893858 0.235583 0.744696 Fe\n0.606142 0.235583 0.244696 Fe\n0.090310 0.860995 0.813288 P\n0.409690 0.860995 0.313288 P\n0.146604 0.530519 0.704044 P\n0.646604 0.469481 0.795956 P\n0.353396 0.530519 0.204044 P\n0.853396 0.469481 0.295956 P\n0.590310 0.139005 0.686712 P\n0.909690 0.139005 0.186712 P\n0.469335 0.025735 0.790309 O\n0.216541 0.938352 0.703497 O\n0.030665 0.025735 0.290309 O\n0.398770 0.868326 0.496975 O\n0.283459 0.938352 0.203497 O\n0.070958 0.629716 0.831189 O\n0.580688 0.672970 0.756917 O\n0.101230 0.868326 0.996975 O\n0.123822 0.675757 0.514275 O\n0.291598 0.509365 0.761945 O\n0.429042 0.629716 0.331189 O\n0.919312 0.672970 0.256917 O\n0.376178 0.675757 0.014275 O\n0.791598 0.490635 0.738055 O\n0.208402 0.509365 0.261945 O\n0.623822 0.324243 0.985725 O\n0.080688 0.327030 0.743083 O\n0.570958 0.370284 0.668811 O\n0.708402 0.490635 0.238055 O\n0.876178 0.324243 0.485725 O\n0.898770 0.131674 0.003025 O\n0.419312 0.327030 0.243083 O\n0.929042 0.370284 0.168811 O\n0.716541 0.061648 0.796503 O\n0.601230 0.131674 0.503025 O\n0.969335 0.974265 0.709691 O\n0.783459 0.061648 0.296503 O\n0.530665 0.974265 0.209691 O\n",
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},
{
"id": "mp-1208628",
"created_at": "2022-09-04T14:39:48.549387Z",
"structure_string": "Sr4 Zn4 F8\n1.0\n7.811946 0.000000 0.000000\n0.000000 7.811946 0.000000\n-3.905973 -3.905973 5.713719\nSr Zn F\n4 4 8\ndirect\n0.625000 0.875000 0.250000 Sr\n0.625000 0.375000 0.250000 Sr\n0.625000 0.375000 0.750000 Sr\n0.125000 0.375000 0.750000 Sr\n0.125000 0.375000 0.250000 Zn\n0.125000 0.875000 0.250000 Zn\n0.125000 0.875000 0.750000 Zn\n0.625000 0.875000 0.750000 Zn\n0.470373 0.161679 0.321278 F\n0.850905 0.159599 0.321278 F\n0.409599 0.220373 0.821278 F\n0.779627 0.588321 0.178722 F\n0.411679 0.600905 0.821278 F\n0.399095 0.590401 0.178722 F\n0.840401 0.529627 0.678722 F\n0.838321 0.149095 0.678722 F\n",
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"density": 3.6388469315325116,
"density_atomic": 0.04588625766608622,
"volume": 348.6882743071318,
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"formula_full": "Sr4 Zn4 F8",
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"updated_at": "2021-11-28T01:34:44.851000Z",
"spacegroup": 141
},
{
"id": "mp-551561",
"created_at": "2022-09-04T14:40:27.679113Z",
"structure_string": "K4 C1 O4\n1.0\n2.853152 5.405515 0.000000\n-2.853152 5.405515 0.000000\n0.000000 2.451678 5.122642\nK C O\n4 1 4\ndirect\n0.812881 0.885351 0.481970 K\n0.513075 0.761116 0.132911 K\n0.114649 0.187119 0.518030 K\n0.238884 0.486925 0.867089 K\n0.742921 0.257079 0.000000 C\n0.801926 0.030873 0.919091 O\n0.969127 0.198074 0.080909 O\n0.504598 0.315456 0.214258 O\n0.684544 0.495402 0.785742 O\n",
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"formula_full": "K4 C1 O4",
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"energy": -48.21122366,
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"spacegroup": 5
},
{
"id": "mp-553374",
"created_at": "2022-09-04T14:47:06.313270Z",
"structure_string": "Cs4 Sb2 O5\n1.0\n3.529460 5.436881 0.000000\n-3.529460 5.436881 0.000000\n0.000000 1.117104 8.227705\nCs Sb O\n4 2 5\ndirect\n0.994938 0.994938 0.004709 Cs\n0.000493 0.000493 0.500338 Cs\n0.336831 0.336831 0.153332 Cs\n0.665754 0.665754 0.846613 Cs\n0.353222 0.353222 0.671793 Sb\n0.648088 0.648088 0.329956 Sb\n0.625635 0.197062 0.787142 O\n0.408642 0.835508 0.191238 O\n0.835508 0.408642 0.191238 O\n0.197062 0.625635 0.787142 O\n0.476907 0.476907 0.465219 O\n",
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],
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"density": 4.496958854851546,
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"volume": 315.7670423987941,
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"formula_full": "Cs4 Sb2 O5",
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{
"id": "mp-1223406",
"created_at": "2022-09-04T14:47:19.697156Z",
"structure_string": "K1 Rb1 Ti4 P6 O24\n1.0\n8.239994 -4.227579 0.000000\n8.239994 4.227579 0.000000\n6.071009 0.000000 6.993767\nK Rb Ti P O\n1 1 4 6 24\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Rb\n0.650337 0.650337 0.650337 Ti\n0.150172 0.150172 0.150172 Ti\n0.349663 0.349663 0.349663 Ti\n0.849828 0.849828 0.849828 Ti\n0.468738 0.750139 0.030897 P\n0.750139 0.030897 0.468738 P\n0.030897 0.468738 0.750139 P\n0.249861 0.969103 0.531262 P\n0.969103 0.531262 0.249861 P\n0.531262 0.249861 0.969103 P\n0.012145 0.649858 0.742740 O\n0.649858 0.742740 0.012145 O\n0.742740 0.012145 0.649858 O\n0.150369 0.512134 0.242384 O\n0.512134 0.242384 0.150369 O\n0.242384 0.150369 0.512134 O\n0.987855 0.350142 0.257260 O\n0.350142 0.257260 0.987855 O\n0.257260 0.987855 0.350142 O\n0.849631 0.487866 0.757616 O\n0.487866 0.757616 0.849631 O\n0.757616 0.849631 0.487866 O\n0.200187 0.430311 0.568516 O\n0.430311 0.568516 0.200187 O\n0.568516 0.200187 0.430311 O\n0.930687 0.701479 0.068567 O\n0.701479 0.068567 0.930687 O\n0.068567 0.930687 0.701479 O\n0.799813 0.569689 0.431484 O\n0.569689 0.431484 0.799813 O\n0.431484 0.799813 0.569689 O\n0.069313 0.298521 0.931433 O\n0.298521 0.931433 0.069313 O\n0.931433 0.069313 0.298521 O\n",
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{
"id": "mp-677454",
"created_at": "2022-09-04T14:39:35.709119Z",
"structure_string": "P12 Pb20 O50\n1.0\n7.473711 0.000000 0.000000\n0.000000 10.003667 0.000000\n0.000000 0.024620 17.333577\nP Pb O\n12 20 50\ndirect\n0.249969 0.138908 0.265017 P\n0.249745 0.082371 0.551346 P\n0.249481 0.034442 0.933701 P\n0.749481 0.965558 0.066299 P\n0.749745 0.917629 0.448654 P\n0.749969 0.861092 0.734983 P\n0.251022 0.635403 0.763974 P\n0.250864 0.573755 0.047843 P\n0.251460 0.535629 0.438447 P\n0.751460 0.464371 0.561553 P\n0.750864 0.426245 0.952157 P\n0.751022 0.364597 0.236026 P\n0.494842 0.244380 0.083527 Pb\n0.005213 0.243799 0.081485 Pb\n0.500636 0.243894 0.415252 Pb\n0.999204 0.244707 0.417363 Pb\n0.731270 0.136528 0.637186 Pb\n0.730753 0.137577 0.863133 Pb\n0.251200 0.994272 0.752304 Pb\n0.751200 0.005728 0.247696 Pb\n0.230753 0.862423 0.136867 Pb\n0.231270 0.863472 0.362814 Pb\n0.499204 0.755293 0.582637 Pb\n0.000636 0.756106 0.584748 Pb\n0.505213 0.756201 0.918515 Pb\n0.994842 0.755620 0.916473 Pb\n0.751855 0.615101 0.123692 Pb\n0.752094 0.626335 0.380032 Pb\n0.231718 0.521188 0.251407 Pb\n0.731718 0.478812 0.748593 Pb\n0.252094 0.373665 0.619968 Pb\n0.251855 0.384899 0.876308 Pb\n0.669509 0.251301 0.750448 O\n0.750999 0.222754 0.195482 O\n0.246922 0.163949 0.176673 O\n0.419583 0.162784 0.577996 O\n0.085792 0.165297 0.580107 O\n0.250858 0.156820 0.988950 O\n0.747173 0.099255 0.019986 O\n0.248012 0.079124 0.461296 O\n0.750560 0.061338 0.414608 O\n0.079111 0.059046 0.291041 O\n0.417831 0.054883 0.288632 O\n0.085345 0.036801 0.877859 O\n0.419562 0.034312 0.880238 O\n0.919562 0.965688 0.119762 O\n0.585345 0.963199 0.122141 O\n0.579111 0.940954 0.708959 O\n0.917831 0.945117 0.711368 O\n0.250560 0.938662 0.585392 O\n0.748012 0.920876 0.538704 O\n0.247173 0.900745 0.980014 O\n0.750858 0.843180 0.011050 O\n0.919583 0.837216 0.422004 O\n0.585792 0.834703 0.419893 O\n0.746922 0.836051 0.823327 O\n0.250999 0.777246 0.804518 O\n0.169509 0.748699 0.249552 O\n0.752052 0.727278 0.688579 O\n0.250900 0.654960 0.675535 O\n0.080229 0.654893 0.070997 O\n0.418454 0.652965 0.075272 O\n0.247257 0.655935 0.493941 O\n0.755171 0.599181 0.513213 O\n0.254707 0.569648 0.956404 O\n0.746885 0.570146 0.920195 O\n0.086751 0.555238 0.793977 O\n0.419963 0.557636 0.792945 O\n0.418462 0.536853 0.384936 O\n0.080969 0.529829 0.386205 O\n0.918462 0.463147 0.615064 O\n0.580969 0.470171 0.613795 O\n0.586751 0.444762 0.206023 O\n0.919963 0.442364 0.207055 O\n0.246885 0.429854 0.079805 O\n0.754707 0.430352 0.043596 O\n0.255171 0.400819 0.486787 O\n0.747257 0.344065 0.506059 O\n0.918454 0.347035 0.924728 O\n0.580229 0.345107 0.929003 O\n0.750900 0.345040 0.324465 O\n0.252052 0.272722 0.311421 O\n",
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{
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"structure_string": "Sn2 P4 H4 O16\n1.0\n0.376115 0.000000 -4.953134\n0.000000 -8.139179 0.000000\n-7.915606 4.069590 0.647446\nSn P H O\n2 4 4 16\ndirect\n0.250000 0.139429 0.000000 Sn\n0.750000 0.860571 0.000000 Sn\n0.197814 0.654033 0.742426 P\n0.302186 0.911607 0.257574 P\n0.802186 0.345967 0.257574 P\n0.697814 0.088393 0.742426 P\n0.157654 0.607137 0.470782 H\n0.342346 0.136355 0.529218 H\n0.842346 0.392863 0.529218 H\n0.657654 0.863645 0.470782 H\n0.994117 0.499658 0.703267 O\n0.505883 0.796390 0.296733 O\n0.005883 0.500342 0.296733 O\n0.494117 0.203610 0.703267 O\n0.467425 0.651183 0.856037 O\n0.032575 0.795146 0.143963 O\n0.532575 0.348817 0.143963 O\n0.967425 0.204854 0.856037 O\n0.060606 0.848496 0.857018 O\n0.439394 0.991479 0.142982 O\n0.939394 0.151504 0.142982 O\n0.560606 0.008521 0.857018 O\n0.279041 0.674847 0.590721 O\n0.220959 0.084126 0.409279 O\n0.720959 0.325153 0.409279 O\n0.779041 0.915874 0.590721 O\n",
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